(2E)-2-(phenylmethylidene)-8-(piperidin-1-ylmethyl)cyclooctan-1-one

Systemtic Name: (2E)-2-(phenylmethylidene)-8-(piperidin-1-ylmethyl)cyclooctan-1-one Openeye Name: (2E)-2-benzylidene-8-(1-piperidylmethyl)cyclooctanone CAS Name: (2E)-2-(phenylmethylene)-8-(1-piperidinylmethyl)-1-cyclooctanone IUPAC Name: (2E)-2-benzylidene-8-(piperidin-1-ylmethyl)cyclooctan-1-one Traditional Name: (2E)-2-benzal-8-(piperidinomethyl)cyclooctanone Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)C(=CC2=CC=CC=C2)CC1)CN3CCCCC3

Isomeric SMILES

C1CCC(C(=O)/C(=C/C2=CC=CC=C2)/CC1)CN3CCCCC3

InChI

InChI=1S/C21H29NO/c23-21-19(16-18-10-4-1-5-11-18)12-6-2-7-13-20(21)17-22-14-8-3-9-15-22/h1,4-5,10-11,16,20H,2-3,6-9,12-15,17H2/b19-16+